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1-Carbobenzyloxy-4-(2-iodobenzyl)piperazine

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

1-Carbobenzyloxy-4-(2-iodobenzyl)piperazine
SpectraBase Compound ID GAq1dp120Ex
InChI InChI=1S/C19H21IN2O2/c20-18-9-5-4-8-17(18)14-21-10-12-22(13-11-21)19(23)24-15-16-6-2-1-3-7-16/h1-9H,10-15H2
InChIKey XRAUEFIYNSFSGJ-UHFFFAOYSA-N
Mol Weight 436.29 g/mol
Molecular Formula C19H21IN2O2
Exact Mass 436.064773 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9epARvD9Fi3
Name 1-Carbobenzyloxy-4-(2-iodobenzyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.064772922 u
Formula C19H21IN2O2
InChI InChI=1S/C19H21IN2O2/c20-18-9-5-4-8-17(18)14-21-10-12-22(13-11-21)19(23)24-15-16-6-2-1-3-7-16/h1-9H,10-15H2
InChIKey XRAUEFIYNSFSGJ-UHFFFAOYSA-N
Molecular Weight 436.293 g/mol
SMILES C(N1CCN(CC1)CC=1C(I)=CC=CC1)(OCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940234